2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane

C106H212N14 — CID 159715575

IUPAC2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane
SMILESCC(C)(C)N1CC2(C1)CN(C(C)(C)C)C2.CC(C)(C)N1CC2CN(C(C)(C)C)CC2C1.CC(C)(C)N1CCC2(CC1)CCN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CC1)CCN(C(C)(C)C)CC2.CC(C)(C)N1CCC2(CCCN(C(C)(C)C)C2)CC1.CC(C)(C)N1CCCC2(C1)CN(C(C)(C)C)C2.CC(C)N1CCC2(CC1)CN(C(C)(C)C)C2
InChIInChI=1S/2C17H34N2.C16H32N2.C15H30N2.2C14H28N2.C13H26N2/c1-15(2,3)18-11-7-17(8-12-18)9-13-19(14-10-17)16(4,5)6;1-15(2,3)18-12-9-17(10-13-18)8-7-11-19(14-17)16(4,5)6;1-14(2,3)17-10-7-16(8-11-17)9-12-18(13-16)15(4,5)6;1-13(2,3)16-9-7-8-15(10-16)11-17(12-15)14(4,5)6;1-13(2,3)15-7-11-9-16(14(4,5)6)10-12(11)8-15;1-12(2)15-8-6-14(7-9-15)10-16(11-14)13(3,4)5;1-11(2,3)14-7-13(8-14)9-15(10-13)12(4,5)6/h2*7-14H2,1-6H3;7-13H2,1-6H3;7-12H2,1-6H3;11-12H,7-10H2,1-6H3;12H,6-11H2,1-5H3;7-10H2,1-6H3
InChIKeyMZJQDVPTYVPPNL-UHFFFAOYSA-N
MW1682.96 g/mol
LogP21.11
Rot. Bonds1

About 2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane

2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane (PubChem CID 159715575) has the molecular formula C106H212N14 and a molecular weight of 1682.96 g/mol. Its IUPAC name is 2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane
PubChem CID159715575
Molecular FormulaC106H212N14
Molecular Weight1682.96 g/mol
Exact Mass1681.70
IUPAC Name2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane
SMILESCC(C)(C)N1CC2(C1)CN(C(C)(C)C)C2.CC(C)(C)N1CC2CN(C(C)(C)C)CC2C1.CC(C)(C)N1CCC2(CC1)CCN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CC1)CCN(C(C)(C)C)CC2.CC(C)(C)N1CCC2(CCCN(C(C)(C)C)C2)CC1.CC(C)(C)N1CCCC2(C1)CN(C(C)(C)C)C2.CC(C)N1CCC2(CC1)CN(C(C)(C)C)C2
InChIInChI=1S/2C17H34N2.C16H32N2.C15H30N2.2C14H28N2.C13H26N2/c1-15(2,3)18-11-7-17(8-12-18)9-13-19(14-10-17)16(4,5)6;1-15(2,3)18-12-9-17(10-13-18)8-7-11-19(14-17)16(4,5)6;1-14(2,3)17-10-7-16(8-11-17)9-12-18(13-16)15(4,5)6;1-13(2,3)16-9-7-8-15(10-16)11-17(12-15)14(4,5)6;1-13(2,3)15-7-11-9-16(14(4,5)6)10-12(11)8-15;1-12(2)15-8-6-14(7-9-15)10-16(11-14)13(3,4)5;1-11(2,3)14-7-13(8-14)9-15(10-13)12(4,5)6/h2*7-14H2,1-6H3;7-13H2,1-6H3;7-12H2,1-6H3;11-12H,7-10H2,1-6H3;12H,6-11H2,1-5H3;7-10H2,1-6H3
InChIKeyMZJQDVPTYVPPNL-UHFFFAOYSA-N
XLogP21.11
TPSA45.36 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds1
Heavy Atoms120
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001682.96
LogP ≤ 521.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane?
The IUPAC name of 2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane (CID 159715575) is 2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane.
What is the SMILES notation for 2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane?
The canonical SMILES for 2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane is CC(C)(C)N1CC2(C1)CN(C(C)(C)C)C2.CC(C)(C)N1CC2CN(C(C)(C)C)CC2C1.CC(C)(C)N1CCC2(CC1)CCN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CC1)CCN(C(C)(C)C)CC2.CC(C)(C)N1CCC2(CCCN(C(C)(C)C)C2)CC1.CC(C)(C)N1CCCC2(C1)CN(C(C)(C)C)C2.CC(C)N1CCC2(CC1)CN(C(C)(C)C)C2.
What is the InChIKey of 2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane?
The InChIKey is MZJQDVPTYVPPNL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C17H34N2.C16H32N2.C15H30N2.2C14H28N2.C13H26N2/c1-15(2,3)18-11-7-17(8-12-18)9-13-19(14-10-17)16(4,5)6;1-15(2,3)18-12-9-17(10-13-18)8-7-11-19(14-17)16(4,5)6;1-14(2,3)17-10-7-16(8-11-17)9-12-18(13-16)15(4,5)6;1-13(2,3)16-9-7-8-15(10-16)11-17(12-15)14(4,5)6;1-13(2,3)15-7-11-9-16(14(4,5)6)10-12(11)8-15;1-12(2)15-8-6-14(7-9-15)10-16(11-14)13(3,4)5;1-11(2,3)14-7-13(8-14)9-15(10-13)12(4,5)6/h2*7-14H2,1-6H3;7-13H2,1-6H3;7-12H2,1-6H3;11-12H,7-10H2,1-6H3;12H,6-11H2,1-5H3;7-10H2,1-6H3.
What are the key properties of 2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane?
2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane has a molecular weight of 1682.96 g/mol, XLogP of 21.11, 1 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-7-propan-2-yl-2,7-diazaspiro[3.5]nonane;2,5-ditert-butyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane;2,9-ditert-butyl-2,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 159715575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).